N-butyl-3-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-N-methyl-imidazo[1,2-a]pyridine-2-carboxamide

Systemtic Name: N-butyl-3-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-N-methyl-imidazo[1,2-a]pyridine-2-carboxamide Openeye Name: N-butyl-3-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-N-methyl-imidazo[1,2-a]pyridine-2-carboxamide CAS Name: N-butyl-3-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-N-methyl-2-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: N-butyl-3-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide Traditional Name: N-butyl-3-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-N-methyl-imidazo[1,2-a]pyridine-2-carboxamide Formula: C24H31ClN5O+ MolecularWeight: 440.98884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H30ClN5O/c1-3-4-11-27(2)24(31)23-21(30-12-6-5-10-22(30)26-23)18-28-13-15-29(16-14-28)20-9-7-8-19(25)17-20/h5-10,12,17H,3-4,11,13-16,18H2,1-2H3/p+1